SCHEMBL8970341

SCHEMBL8970341

Cc1cccc(-c2cnc(N)c(C(=O)c3cccc(N4CCCCCC4)n3)c2)c1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 15/20 0.52
PRKCA P17252 2/20 0.50
PRKCD Q05655 2/20 0.50
HSD17B14 Q9BPX1 1/20 0.44
BMPR1B O00238 1/20 0.41
BMPR1A P36894 1/20 0.41
TGFBR1 P36897 1/20 0.41
ACVRL1 P37023 1/20 0.41
ACVR1 Q04771 1/20 0.41
AXL P30530 1/20 0.41
MERTK Q12866 1/20 0.41
HSD11B1 P28845 1/20 0.41
GRIN2B Q13224 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8969842 0.91 PRKCQ (0.53) PRKCQPRKCAPRKCDHSD17B14BMPR1B
SCHEMBL9011520 0.91 PRKCQ (0.65) PRKCQPRKCAPRKCD
SCHEMBL8970308 0.90 PRKCQ (0.52) PRKCQPRKCAPRKCDHSD17B14BMPR1B
SCHEMBL8969820 0.90 PRKCQ (0.53) PRKCQPRKCAPRKCDHSD17B14BMPR1B
SCHEMBL8970317 0.89 PRKCQ (0.51) PRKCQPRKCAPRKCDHSD17B14BMPR1B
SCHEMBL8970228 0.87 PRKCQ (0.50) PRKCQPRKCAPRKCDHSD17B14TGFBR1
SCHEMBL8970237 0.87 PRKCQ (0.58) PRKCQPRKCAPRKCDHSD17B14HSD11B1
SCHEMBL8970354 0.87 PRKCQ (0.53) PRKCQPRKCAPRKCDHSD17B14BMPR1B
SCHEMBL8970007 0.86 PRKCQ (0.55) PRKCQPRKCAPRKCDHSD17B14
SCHEMBL8970311 0.86 PRKCQ (0.52) PRKCQPRKCAPRKCDHSD17B14BMPR1B

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8188071-B2 Amino substituted pyridines as potent kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-05-29 US disclosed